SCHEMBL29144159

SCHEMBL29144159

COc1cc(-c2nccc(-c3cccc(NC(=O)c4ccc(COC(=O)NC(C)(C)C)cn4)c3C)c2Cl)ccc1CNCCO

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 20/20 0.58
▸ PDCD1 Q15116 18/20 0.58

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29143997 0.93 CD274 (0.49) CD274PDCD1
SCHEMBL27079628 0.90 CD274 (0.66) CD274PDCD1
SCHEMBL29982521 0.90 CD274 (0.66) CD274PDCD1
SCHEMBL29144160 0.88 CD274 (0.58) CD274PDCD1
SCHEMBL29144002 0.88 CD274 (0.44) CD274PDCD1
SCHEMBL29144153 0.87 CD274 (0.62) CD274PDCD1
SCHEMBL29143977 0.85 CD274 (0.65) CD274PDCD1
SCHEMBL29981849 0.85 CD274 (0.62) CD274PDCD1
SCHEMBL27078776 0.85 CD274 (0.62) CD274PDCD1
SCHEMBL29983310 0.82 CD274 (0.62) CD274PDCD1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117412959-A Substituted 1-aryl-1 '-heteroaryl compounds, substituted 1,1' -biaryl compounds, and methods of use thereof 爱彼特生物制药公司 2024-01-16 — — CN disclosed
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